Fan T - Search Results

1

Assessment of the rat acute oral toxicity of quinoline-based pharmaceutical scaffold molecules using QSTR, q-RASTR and machine learning methods.

Xu J, Ren T, Li F, Chen S, Fan T, Zhao L, Zhong R, Sun G, Lin N. Xu J, et al. Among authors: fan t. Mol Divers. 2025 Jun 27. doi: 10.1007/s11030-025-11265-9. Online ahead of print. Mol Divers. 2025. PMID: 40576892

2

QSAR and Classification Study on Prediction of Acute Oral Toxicity of N-Nitroso Compounds.

Fan T, Sun G, Zhao L, Cui X, Zhong R. Fan T, et al. Int J Mol Sci. 2018 Oct 3;19(10):3015. doi: 10.3390/ijms19103015. Int J Mol Sci. 2018. PMID: 30282923 Free PMC article.

3

The rat acute oral toxicity of trifluoromethyl compounds (TFMs): a computational toxicology study combining the 2D-QSTR, read-across and consensus modeling methods.

Lu X, Wang X, Chen S, Fan T, Zhao L, Zhong R, Sun G. Lu X, et al. Among authors: fan t. Arch Toxicol. 2024 Jul;98(7):2213-2229. doi: 10.1007/s00204-024-03739-w. Epub 2024 Apr 16. Arch Toxicol. 2024. PMID: 38627326

4

Identification of the Structural Features of Guanine Derivatives as MGMT Inhibitors Using 3D-QSAR Modeling Combined with Molecular Docking.

Sun G, Fan T, Zhang N, Ren T, Zhao L, Zhong R. Sun G, et al. Among authors: fan t. Molecules. 2016 Jun 23;21(7):823. doi: 10.3390/molecules21070823. Molecules. 2016. PMID: 27347909 Free PMC article.

5

The potential of combi-molecules with DNA-damaging function as anticancer agents.

Sun G, Fan T, Zhao L, Zhou Y, Zhong R. Sun G, et al. Among authors: fan t. Future Med Chem. 2017 Mar;9(4):403-435. doi: 10.4155/fmc-2016-0229. Epub 2017 Mar 6. Future Med Chem. 2017. PMID: 28263086 Review.

6

In Silico Prediction of O⁶-Methylguanine-DNA Methyltransferase Inhibitory Potency of Base Analogs with QSAR and Machine Learning Methods.

Sun G, Fan T, Sun X, Hao Y, Cui X, Zhao L, Ren T, Zhou Y, Zhong R, Peng Y. Sun G, et al. Among authors: fan t. Molecules. 2018 Nov 6;23(11):2892. doi: 10.3390/molecules23112892. Molecules. 2018. PMID: 30404161 Free PMC article.

7

Prediction on the mutagenicity of nitroaromatic compounds using quantum chemistry descriptors based QSAR and machine learning derived classification methods.

Hao Y, Sun G, Fan T, Sun X, Liu Y, Zhang N, Zhao L, Zhong R, Peng Y. Hao Y, et al. Among authors: fan t. Ecotoxicol Environ Saf. 2019 Dec 30;186:109822. doi: 10.1016/j.ecoenv.2019.109822. Epub 2019 Oct 18. Ecotoxicol Environ Saf. 2019. PMID: 31634658

8

Reductive Activity and Mechanism of Hypoxia- Targeted AGT Inhibitors: An Experimental and Theoretical Investigation.

Xiao W, Sun G, Fan T, Liu J, Zhang N, Zhao L, Zhong R. Xiao W, et al. Among authors: fan t. Int J Mol Sci. 2019 Dec 13;20(24):6308. doi: 10.3390/ijms20246308. Int J Mol Sci. 2019. PMID: 31847200 Free PMC article.

9

In vivo toxicity of nitroaromatic compounds to rats: QSTR modelling and interspecies toxicity relationship with mouse.

Hao Y, Sun G, Fan T, Tang X, Zhang J, Liu Y, Zhang N, Zhao L, Zhong R, Peng Y. Hao Y, et al. Among authors: fan t. J Hazard Mater. 2020 Nov 15;399:122981. doi: 10.1016/j.jhazmat.2020.122981. Epub 2020 May 27. J Hazard Mater. 2020. PMID: 32534390

10

Identification of Pharmacophoric Fragments of DYRK1A Inhibitors Using Machine Learning Classification Models.

Bi M, Guan Z, Fan T, Zhang N, Wang J, Sun G, Zhao L, Zhong R. Bi M, et al. Among authors: fan t. Molecules. 2022 Mar 8;27(6):1753. doi: 10.3390/molecules27061753. Molecules. 2022. PMID: 35335117 Free PMC article.

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